6-chloro-8-(3,3-difluoropyrrolidin-1-yl)imidazo[1,2-b]pyridazine

C10H9ClF2N4 — CID 157033725

IUPAC6-chloro-8-(3,3-difluoropyrrolidin-1-yl)imidazo[1,2-b]pyridazine
SMILESFC1(F)CCN(c2cc(Cl)nn3ccnc23)C1
InChIInChI=1S/C10H9ClF2N4/c11-8-5-7(9-14-2-4-17(9)15-8)16-3-1-10(12,13)6-16/h2,4-5H,1,3,6H2
InChIKeyZQZHIKXDZODPKZ-UHFFFAOYSA-N
MW258.66 g/mol
LogP2.23
Rot. Bonds1

About 6-chloro-8-(3,3-difluoropyrrolidin-1-yl)imidazo[1,2-b]pyridazine

6-chloro-8-(3,3-difluoropyrrolidin-1-yl)imidazo[1,2-b]pyridazine (PubChem CID 157033725) has the molecular formula C10H9ClF2N4 and a molecular weight of 258.66 g/mol. Its IUPAC name is 6-chloro-8-(3,3-difluoropyrrolidin-1-yl)imidazo[1,2-b]pyridazine.

Molecular Properties

Compound Name6-chloro-8-(3,3-difluoropyrrolidin-1-yl)imidazo[1,2-b]pyridazine
PubChem CID157033725
Molecular FormulaC10H9ClF2N4
Molecular Weight258.66 g/mol
Exact Mass258.05
IUPAC Name6-chloro-8-(3,3-difluoropyrrolidin-1-yl)imidazo[1,2-b]pyridazine
SMILESFC1(F)CCN(c2cc(Cl)nn3ccnc23)C1
InChIInChI=1S/C10H9ClF2N4/c11-8-5-7(9-14-2-4-17(9)15-8)16-3-1-10(12,13)6-16/h2,4-5H,1,3,6H2
InChIKeyZQZHIKXDZODPKZ-UHFFFAOYSA-N
XLogP2.23
TPSA33.43 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.66
LogP ≤ 52.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-chloro-8-(3,3-difluoropyrrolidin-1-yl)imidazo[1,2-b]pyridazine?
The IUPAC name of 6-chloro-8-(3,3-difluoropyrrolidin-1-yl)imidazo[1,2-b]pyridazine (CID 157033725) is 6-chloro-8-(3,3-difluoropyrrolidin-1-yl)imidazo[1,2-b]pyridazine.
What is the SMILES notation for 6-chloro-8-(3,3-difluoropyrrolidin-1-yl)imidazo[1,2-b]pyridazine?
The canonical SMILES for 6-chloro-8-(3,3-difluoropyrrolidin-1-yl)imidazo[1,2-b]pyridazine is FC1(F)CCN(c2cc(Cl)nn3ccnc23)C1.
What is the InChIKey of 6-chloro-8-(3,3-difluoropyrrolidin-1-yl)imidazo[1,2-b]pyridazine?
The InChIKey is ZQZHIKXDZODPKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9ClF2N4/c11-8-5-7(9-14-2-4-17(9)15-8)16-3-1-10(12,13)6-16/h2,4-5H,1,3,6H2.
What are the key properties of 6-chloro-8-(3,3-difluoropyrrolidin-1-yl)imidazo[1,2-b]pyridazine?
6-chloro-8-(3,3-difluoropyrrolidin-1-yl)imidazo[1,2-b]pyridazine has a molecular weight of 258.66 g/mol, XLogP of 2.23, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-8-(3,3-difluoropyrrolidin-1-yl)imidazo[1,2-b]pyridazine is sourced from PubChem (CID 157033725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).